⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL24594528 | 0.87 | MEN1 (0.38) | — | |
| SCHEMBL26772407 | 0.84 | MEN1 (0.39) | — | |
| SCHEMBL23985914 | 0.84 | MEN1 (0.30) | — | |
| SCHEMBL23050654 | 0.81 | — | — | |
| SCHEMBL22547545 | 0.81 | MEN1 (0.33) | — | |
| SCHEMBL16189197 | 0.79 | MEN1 (0.33) | — | |
| SCHEMBL16189195 | 0.78 | MEN1 (0.33) | — | |
| SCHEMBL22596735 | 0.78 | MEN1 (0.33) | — | |
| SCHEMBL19275956 | 0.78 | MEN1 (0.33) | — | |
| SCHEMBL26772405 | 0.77 | MEN1 (0.35) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3439063-A1 | ORGANIC LIGHT-EMITTING DEVICE | Samsung Electronics Co., Ltd. (KR) | 2019-02-06 | — | — | EP | disclosed |